1-(2-butoxy-3-octylsulfanyl-propyl)imidazole; ethanedioic acid

Systemtic Name: 1-(2-butoxy-3-octylsulfanyl-propyl)imidazole; ethanedioic acid Openeye Name: 1-(2-butoxy-3-octylsulfanyl-propyl)imidazole; oxalic acid CAS Name: 1-[2-butoxy-3-(octylthio)propyl]imidazole; oxalic acid IUPAC Name: 1-(2-butoxy-3-octylsulfanylpropyl)imidazole; oxalic acid Traditional Name: 1-[2-butoxy-3-(octylthio)propyl]imidazole; oxalic acid Formula: C20H36N2O5S MolecularWeight: 416.57524

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCSCC(CN1C=CN=C1)OCCCC.C(=O)(C(=O)O)O

Isomeric SMILES

CCCCCCCCSCC(CN1C=CN=C1)OCCCC.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H34N2OS.C2H2O4/c1-3-5-7-8-9-10-14-22-16-18(21-13-6-4-2)15-20-12-11-19-17-20;3-1(4)2(5)6/h11-12,17-18H,3-10,13-16H2,1-2H3;(H,3,4)(H,5,6)